Basic information
- CAS
1016520-74-3- Standard SMILES
Cc1cccc(-c2nc(N)n[nH]2)n1- InChIKey
IPWZWBDTLMLQND-UHFFFAOYSA-N- Molecular formula
- C8H9N5
- Average molar mass
- 175.19 g/mol
- Monoisotopic mass
- 175.08579531
Names & identifiers
- Preferred name
- 5-(6-methylpyridin-2-yl)-4H-1,2,4-triazol-3-amine
- IUPAC
- 5-(6-methyl-2-pyridinyl)-1H-1,2,4-triazol-3-amine
Names & synonyms
5-(6-methylpyridin-2-yl)-4H-1,2,4-triazol-3-amine1016520-74-3RefChem:530590859-584-85-(6-methylpyridin-2-yl)-1H-1,2,4-triazol-3-amine5-Amino-3-(6-methyl-2-pyridyl)-1H-1,2,4-triazoleMFCD09811080AKOS000163569SY176397CS-0247605EN300-36995G24285
Show more names
AB00999556-01Z285159052
Database identifiers
- CAS
1016520-74-3- PubChem CID
- 20121101
- EC Number
- 859-584-8
Properties
Computed structural properties
- XLogP
- 0.7
- Topological polar surface area
- 80.5 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 1
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 174
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
GHS classification
GHS Classification
Warning
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)
The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.
Hazard information
Hazard Classes and CategoriesAcute Tox. 4 (100%)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…